SCHEMBL8540879

SCHEMBL8540879

Cc1nccn1CCCCCCn1ccnc1C

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.77
KMT2A Q03164 2/20 0.77
POLB P06746 1/20 0.77
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
TSHR P16473 1/20 0.53
P2RX7 Q99572 1/20 0.51
TLR8 Q9NR97 2/20 0.50
KDM4E B2RXH2 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
FDPS P14324 1/20 0.44
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPK1 P28482 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL32685227 1.00 ALDH1A1 (0.77) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL25010694 1.00 ALDH1A1 (0.77) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL25009512 0.98 ALDH1A1 (0.80) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL27090339 0.93 ALDH1A1 (0.80) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL2328687 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL25267924 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL25267373 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL5287541 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL363481 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1
SCHEMBL1137200 0.92 ALDH1A1 (0.85) ALDH1A1KMT2APOLBCA12CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 EP claimed
WO-2023010200-A1 THERAPEUTIC COORDINATION POLYMERS CONTAINING PHARMACEUTICALS FOR DRUG RELEASE APPLICATIONS UNIVERSITY OF WINDSOR (CA) 2023-02-09 WO disclosed
CN-109037741-A A kind of pyrazoles type anion-exchange membrane of high stability and preparation method thereof 常州大学 2018-12-18 CN disclosed
US-5750532-A TETRAHYDROPYRIMIDINE-2,4-DIONE DERIVATIVES, VIRICIDES, ANTIINFLAMMATORY AGENTS, PAF INHIBITORS SCHERING CORPORATION (US) 1998-05-12 US disclosed
US-5459144-A Enterovirus and rhinovirus antiviral, antiinflammatory and antagonist of platelet activating factor SCHERING CORPORATION (US) 1995-10-17 US disclosed
US-5272167-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-12-21 US disclosed
EP-0560407-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1993-09-15 EP disclosed
WO-1991000858-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS SCHERING CORPORATION (US) 1991-01-24 WO disclosed
EP-0407217-A1 Pharmaceutically active compounds SCHERING CORPORATION (US) 1991-01-09 EP disclosed
US-4851423-A Pharmaceutically active compounds SCHERING CORPORATION (US) 1989-07-25 US disclosed
EP-0274867-A2 Pharmaceutically active compounds SCHERING CORPORATION (US) 1988-07-20 EP disclosed